smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cccc(/C=[NH+]/CCCC/[NH+]=C/c2cccc(OC)c2)c1	ZINC000006794017	525769326	/nfs/dbraw/zinc/76/93/26/525769326.db2.gz	SSPNKXIRNJTWIJ-YHARCJFQSA-N	2	2	324.424	4.022	40	30		DIEBLP
Oc1ccccc1/C=[NH+]\CCCCCC/[NH+]=C\c1ccccc1O	ZINC000095548005	332170620	/nfs/dbraw/zinc/17/06/20/332170620.db2.gz	DXVHKINVBJRBGQ-BMJUYKDLSA-N	2	2	324.424	4.196	40	30		DIEBLP
COc1ccc(/C=[NH+]/CCCC/[NH+]=C/c2ccc(OC)cc2)cc1	ZINC000100406819	563550459	/nfs/dbraw/zinc/55/04/59/563550459.db2.gz	UOLGXDNOQHHLBL-YHARCJFQSA-N	2	2	324.424	4.022	40	30		DIEBLP
Fc1ccc(/C=[NH+]/CCCC/[NH+]=C/c2ccc(F)cc2)cc1	ZINC000016400324	563412224	/nfs/dbraw/zinc/41/22/24/563412224.db2.gz	OLYIMRNPVDFZSN-JFMUQQRKSA-N	2	2	300.352	4.283	40	30		DIEBLP